methyl 3-(2,2-diphenylethanoylamino)-4-piperidin-1-yl-benzoate

Systemtic Name: methyl 3-(2,2-diphenylethanoylamino)-4-piperidin-1-yl-benzoate Openeye Name: methyl 3-[(2,2-diphenylacetyl)amino]-4-(1-piperidyl)benzoate CAS Name: 3-[(1-oxo-2,2-diphenylethyl)amino]-4-(1-piperidinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[(2,2-diphenylacetyl)amino]-4-piperidin-1-ylbenzoate Traditional Name: 3-[(2,2-diphenylacetyl)amino]-4-piperidino-benzoic acid methyl ester Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N2CCCCC2)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2CCCCC2)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H28N2O3/c1-32-27(31)22-15-16-24(29-17-9-4-10-18-29)23(19-22)28-26(30)25(20-11-5-2-6-12-20)21-13-7-3-8-14-21/h2-3,5-8,11-16,19,25H,4,9-10,17-18H2,1H3,(H,28,30)